(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-N-(2-hydroxyethyl)-6,8,10,14-icosatetraenamide
[CAS# 877459-63-7]

Identification

• Name: (5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-N-(2-hydroxyethyl)-6,8,10,14-icosatetraenamide
• Synonyms: LTB4 ethanol amide; N-(2-hydroxyethyl)-5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraen-1-amide; LMFA03020012
• Molecular Formula: C₂₂H₃₇NO₄
• Molecular Weight: 379.53
• CAS Registry Number: 877459-63-7
• SMILES: O=C(NCCO)CCC[C@H](O)/C=C\C=C\C=C\[C@H](O)C\C=C/CCCCC
• InChI: 1S/C22H37NO4/c1-2-3-4-5-6-9-13-20(25)14-10-7-8-11-15-21(26)16-12-17-22(27)23-18-19-24/h6-11,14-15,20-21,24-26H,2-5,12-13,16-19H2,1H3,(H,23,27)/b8-7+,9-6-,14-10+,15-11-/t20-,21-/m1/s1
• InChIKey: DQLVVNIINUTUIU-XLFGVTECSA-N

Properties

• Density: 1.039g/cm³ (Cal.)
• Boiling point: 617.638°C at 760 mmHg (Cal.)
• Flash point: 327.336°C (Cal.)
• Refractive index: 1.527 (Cal.)